N-(6,7,8,9,10,11-hexahydrocycloocta[b][1]benzofuran-2-yl)morpholine-4-carboxamide

C19H24N2O3 — CID 24898077

IUPACN-(6,7,8,9,10,11-hexahydrocycloocta[b][1]benzofuran-2-yl)morpholine-4-carboxamide
SMILESO=C(Nc1ccc2oc3c(c2c1)CCCCCC3)N1CCOCC1
InChIInChI=1S/C19H24N2O3/c22-19(21-9-11-23-12-10-21)20-14-7-8-18-16(13-14)15-5-3-1-2-4-6-17(15)24-18/h7-8,13H,1-6,9-12H2,(H,20,22)
InChIKeyUQGLQEQUUJNCSG-UHFFFAOYSA-N
MW328.41 g/mol
LogP3.96
Rot. Bonds1

About N-(6,7,8,9,10,11-hexahydrocycloocta[b][1]benzofuran-2-yl)morpholine-4-carboxamide

N-(6,7,8,9,10,11-hexahydrocycloocta[b][1]benzofuran-2-yl)morpholine-4-carboxamide (PubChem CID 24898077) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is N-(6,7,8,9,10,11-hexahydrocycloocta[b][1]benzofuran-2-yl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(6,7,8,9,10,11-hexahydrocycloocta[b][1]benzofuran-2-yl)morpholine-4-carboxamide
PubChem CID24898077
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC NameN-(6,7,8,9,10,11-hexahydrocycloocta[b][1]benzofuran-2-yl)morpholine-4-carboxamide
SMILESO=C(Nc1ccc2oc3c(c2c1)CCCCCC3)N1CCOCC1
InChIInChI=1S/C19H24N2O3/c22-19(21-9-11-23-12-10-21)20-14-7-8-18-16(13-14)15-5-3-1-2-4-6-17(15)24-18/h7-8,13H,1-6,9-12H2,(H,20,22)
InChIKeyUQGLQEQUUJNCSG-UHFFFAOYSA-N
XLogP3.96
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(6,7,8,9,10,11-hexahydrocycloocta[b][1]benzofuran-2-yl)morpholine-4-carboxamide?
The IUPAC name of N-(6,7,8,9,10,11-hexahydrocycloocta[b][1]benzofuran-2-yl)morpholine-4-carboxamide (CID 24898077) is N-(6,7,8,9,10,11-hexahydrocycloocta[b][1]benzofuran-2-yl)morpholine-4-carboxamide.
What is the SMILES notation for N-(6,7,8,9,10,11-hexahydrocycloocta[b][1]benzofuran-2-yl)morpholine-4-carboxamide?
The canonical SMILES for N-(6,7,8,9,10,11-hexahydrocycloocta[b][1]benzofuran-2-yl)morpholine-4-carboxamide is O=C(Nc1ccc2oc3c(c2c1)CCCCCC3)N1CCOCC1.
What is the InChIKey of N-(6,7,8,9,10,11-hexahydrocycloocta[b][1]benzofuran-2-yl)morpholine-4-carboxamide?
The InChIKey is UQGLQEQUUJNCSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c22-19(21-9-11-23-12-10-21)20-14-7-8-18-16(13-14)15-5-3-1-2-4-6-17(15)24-18/h7-8,13H,1-6,9-12H2,(H,20,22).
What are the key properties of N-(6,7,8,9,10,11-hexahydrocycloocta[b][1]benzofuran-2-yl)morpholine-4-carboxamide?
N-(6,7,8,9,10,11-hexahydrocycloocta[b][1]benzofuran-2-yl)morpholine-4-carboxamide has a molecular weight of 328.41 g/mol, XLogP of 3.96, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6,7,8,9,10,11-hexahydrocycloocta[b][1]benzofuran-2-yl)morpholine-4-carboxamide is sourced from PubChem (CID 24898077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).